RefMet Compound Details

RefMet ID, RefMet name, exact mass and formula
RefMet ID	RM0204665
RefMet name	Naringenin chalcone
Synonyms	PubChem Synonyms
Exact mass	272.068475 (neutral)	Calculate m/z: (Choose adduct) [M+H]+ [M+H-H2O]+ [M.]+ [M+2H]2+ [M+3H]3+ [M+4H]4+ [M+K]+ [M+2K]2+ [M+2K-H]+ [M+Na]+ [M+2Na]2+ [M+2Na-H]+ [M+Li]+ [M+2Li]2+ [M+NH4]+ [M.CH3]+ [M+Ag]+ [M+H+CH3OH]+ [M+H+CH3CN]+ [M+H+2CH3CN]+ [M+Na+CH3CN]+ [M.NaFormate+H]+ [M.NH4Formate+H]+ [M.TMSi]+ [M.tBuDMSi]+ [M+H-Hexose]+ [M+H-EtnP]+ [M+H-SerP]+ [M-H]- [M-H-H2O]- [M-CH3]- [M-2H]2- [M-3H]3- [M-4H]4- [M+Cl]- [M+OAc]- [M+Na-2H]- [M+K-2H]- [M.Formate]- [M.NaFormate-H]- [M.NH4Formate-H]- [M.F]- [M-H-Ser]- [M.HF2]- M(neutral)    View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
Formula	C15H12O5	View other entries in RefMet with this formula
Molecular descriptors
Molfile	26740 (Download molfile/View MW Metabolite Database details)
InChI
InChIKey	YQHMWTPYORBCMF-ZZXKWVIFSA-N	View other enantiomers/diastereomers of this metabolite in RefMet
SMILES	c1cc(ccc1/C=C/C(=O)c1c(cc(cc1O)O)O)O Run Tanimoto similarity search (with similarity coefficient >=0.6)
Chemical/Biochemical Classification
Super Class	Polyketides
Main Class	Flavonoids
Sub Class	Chalcones
Distribution of Naringenin chalcone in NMDR studies
Species	Plot Species distribution
Sample source	Plot Sample source(tissue) distribution
Platform	Platform (MS/NMR) used for detection
Chromatography	Chromatography methods used for detection
Studies	NMDR Studies reporting Naringenin chalcone
External Links
Pubchem CID	5280960
LIPID MAPS	LMPK12120264
ChEBI ID	15413
KEGG ID	C06561
HMDB ID	HMDB0029631
Chemspider ID	4444447
MetaCyc ID	APIGENIN
Spectral data for Naringenin chalcone standards
MassBank(EU)	View MS spectra
Structural annotation level
Annotation level	1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)